1-{2-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}propan-1-one
Chemical Structure Depiction of
1-{2-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}propan-1-one
1-{2-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}propan-1-one
Compound characteristics
| Compound ID: | P025-0279 |
| Compound Name: | 1-{2-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}propan-1-one |
| Molecular Weight: | 447.62 |
| Molecular Formula: | C22 H29 N3 O3 S2 |
| Smiles: | CCC(N1CCc2c(C1)cc(s2)S(N1CCN(CC1)c1cc(C)ccc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1459 |
| logD: | 4.1459 |
| logSw: | -4.1015 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.981 |
| InChI Key: | HXRJKLRCDWONQL-UHFFFAOYSA-N |